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4-methyl-2-hexanol
2-hexanol, 4-methyl-

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CAS Number: 2313-61-3Picture of molecule3D/inchi
FDA UNII: Search
Nikkaji Web:J265.476H
XlogP3-AA:2.20 (est)
Molecular Weight:116.20372000
Formula:C7 H16 O
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
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Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 152.00 to 153.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:1.282000 mmHg @ 25.00 °C. (est)
Flash Point: 125.00 °F. TCC ( 51.60 °C. ) (est)
logP (o/w): 2.055 (est)
Soluble in:
 alcohol
 water, 4725 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
4-Methyl-2-hexanol
 
Safety Information:
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
natural substances and extractives
Recommendation for 4-methyl-2-hexanol usage levels up to:
 not for fragrance use.
 
Recommendation for 4-methyl-2-hexanol flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :123156
National Institute of Allergy and Infectious Diseases:Data
4-methylhexan-2-ol
Chemidplus:0002313613
 
References:
 4-methylhexan-2-ol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):123156
Pubchem (sid):135079033
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 meat
Search PMC Picture
 
Synonyms:
2-hexanol, 4-methyl-
4-methyl hexan-2-ol
4-methylhexan-2-ol
 
 
Notes:
None found
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